CHEBI:86580 - 4-acetoxycinnamic acid

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ChEBI Name 4-acetoxycinnamic acid ChEBI ID CHEBI:86580 Definition An acetate ester obtained by the formal condensation of the hydroxy group of trans-4-coumaric acid with acetic acid. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C11H10O4 Net Charge 0 Average Mass 206.19470 Monoisotopic Mass 206.05791 InChI InChI=1S/C11H10O4/c1-8(12)15-10-5-2-9(3-6-10)4-7-11(13)14/h2-7H,1H3,(H,13,14)/b7-4+ InChIKey BYHBHNKBISXCEP-QPJJXVBHSA-N SMILES CC(=O)Oc1ccc(\C=C\C(O)=O)cc1 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing 4-acetoxycinnamic acid (CHEBI:86580) has functional parent trans-4-coumaric acid (CHEBI:32374) 4-acetoxycinnamic acid (CHEBI:86580) is a cinnamic acids (CHEBI:23252) 4-acetoxycinnamic acid (CHEBI:86580) is a phenyl acetates (CHEBI:140310) IUPAC Name (2E)-3-[4-(acetyloxy)phenyl]prop-2-enoic acid Synonym Source acetylated coumaric acid ChEBI Registry Number Type Source 2806111 Reaxys Registry Number Reaxys Last Modified 03 April 2018